CID 67135623

2-(dibenzylamino)-2-methylpropan-1-ol

Structural Information

Molecular Formula
C18H23NO
SMILES
CC(C)(CO)N(CC1=CC=CC=C1)CC2=CC=CC=C2
InChI
InChI=1S/C18H23NO/c1-18(2,15-20)19(13-16-9-5-3-6-10-16)14-17-11-7-4-8-12-17/h3-12,20H,13-15H2,1-2H3
InChIKey
UKKNPSFYBMISHH-UHFFFAOYSA-N
Compound name
2-(dibenzylamino)-2-methylpropan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

18
Patents

269.17798 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 270.18526 165.6
[M+Na]+ 292.16720 169.7
[M-H]- 268.17070 171.5
[M+NH4]+ 287.21180 181.2
[M+K]+ 308.14114 166.3
[M+H-H2O]+ 252.17524 157.7
[M+HCOO]- 314.17618 187.3
[M+CH3COO]- 328.19183 202.2
[M+Na-2H]- 290.15265 171.4
[M]+ 269.17743 165.7
[M]- 269.17853 165.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe